3-methyl-4-(1-phenylbutylamino)benzoic acid

Systemtic Name: 3-methyl-4-(1-phenylbutylamino)benzoic acid Openeye Name: 3-methyl-4-(1-phenylbutylamino)benzoic acid CAS Name: 3-methyl-4-(1-phenylbutylamino)benzoic acid IUPAC Name: 3-methyl-4-(1-phenylbutylamino)benzoic acid Traditional Name: 3-methyl-4-(1-phenylbutylamino)benzoic acid Formula: C18H21NO2 MolecularWeight: 283.36484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC2=C(C=C(C=C2)C(=O)O)C

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC2=C(C=C(C=C2)C(=O)O)C

InChI

InChI=1S/C18H21NO2/c1-3-7-17(14-8-5-4-6-9-14)19-16-11-10-15(18(20)21)12-13(16)2/h4-6,8-12,17,19H,3,7H2,1-2H3,(H,20,21)